John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=C3BrAKpvP9N SpectraBase Spectrum ID=28XPdyUnggw

(accessed ).
(8-BETA,9-BETA,13-BETA,14-BETA)-16-(4-BROMOPHENYL)-11-HYDROXYIMINO-3-METHOXY-18-NOR-16-AZAESTRA-1,3,5(10)-TRIENE-15,17-DIONE
SpectraBase Compound ID C3BrAKpvP9N
InChI InChI=1S/C23H21BrN2O4/c1-30-15-7-9-16-12(10-15)2-8-17-20(16)19(25-29)11-18-21(17)23(28)26(22(18)27)14-5-3-13(24)4-6-14/h3-7,9-10,17-18,20-21,29H,2,8,11H2,1H3/b25-19+
InChIKey ZABQYWPEUGCIED-NCELDCMTSA-N
Mol Weight 469.34 g/mol
Molecular Formula C23H21BrN2O4
Exact Mass 468.068468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 28XPdyUnggw
Name (8-BETA,9-BETA,13-BETA,14-BETA)-16-(4-BROMOPHENYL)-11-HYDROXYIMINO-3-METHOXY-18-NOR-16-AZAESTRA-1,3,5(10)-TRIENE-15,17-DIONE
Compound Number 8B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H20BrN2O4
InChI InChI=1S/C23H21BrN2O4/c1-30-15-7-9-16-12(10-15)2-8-17-20(16)19(25-29)11-18-21(17)23(28)26(22(18)27)14-5-3-13(24)4-6-14/h3-7,9-10,17-18,20-21,29H,2,8,11H2,1H3/b25-19+
InChIKey ZABQYWPEUGCIED-NCELDCMTSA-N
Literature Reference Author A.SULTANI,H.DIETRICH,F.RICHTER,H.H.OTTO
Literature Reference Citation MH.CHEM.,136,1651(2005)
Literature Reference DOI 10.1007/s00706-005-0344-5
Molecular Weight 468.327 g/mol
Solvent DMSO-D6
Source File Reference UWSI23648
SpectraBase Batch ID 3pPyzL13Dys